N-[1-[(3-azanyl-2-oxidanyl-propyl)amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(2-phenylmethoxypropanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[(3-azanyl-2-oxidanyl-propyl)amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-1-(2-phenylmethoxypropanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[2-[(3-amino-2-hydroxy-propyl)amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-1-(2-benzyloxypropanoyl)pyrrolidine-2-carboxamide CAS Name: N-[1-[(3-amino-2-hydroxypropyl)amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-1-(1-oxo-2-phenylmethoxypropyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[(3-amino-2-hydroxypropyl)amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-1-(2-phenylmethoxypropanoyl)pyrrolidine-2-carboxamide Traditional Name: N-[2-[(3-amino-2-hydroxy-propyl)amino]-2-keto-1-(2-naphthylmethyl)ethyl]-1-(2-benzoxypropanoyl)pyrrolidine-2-carboxamide Formula: C31H38N4O5 MolecularWeight: 546.65722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(CN)O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)NC(CC2=CC3=CC=CC=C3C=C2)C(=O)NCC(CN)O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H38N4O5/c1-21(40-20-22-8-3-2-4-9-22)31(39)35-15-7-12-28(35)30(38)34-27(29(37)33-19-26(36)18-32)17-23-13-14-24-10-5-6-11-25(24)16-23/h2-6,8-11,13-14,16,21,26-28,36H,7,12,15,17-20,32H2,1H3,(H,33,37)(H,34,38)